Ethyl 13-docosenoate
TL;DR: Ethyl 13-docosenoate (CAS 37910-77-3) is a chemical compound with molecular formula C24H46O2 and molecular weight 366.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl docos-13-enoate
Also Known As: Ethyl erucate, ethyl 13-docosenoate, ethyl docos-13-enoate, Erucic acid ethyl ester, cis-13-Docosenoic acid ethyl ester
| Molecular Formula | C24H46O2 |
|---|---|
| Molecular Weight | 366.35 g/mol |
| LogP | 10.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 21 |
| Exact Mass | 366.3498 |
| Heavy Atoms | 26 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 37910-77-3 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCCCCCC(=O)OCC |
| InChIKey | WFZQLUSOXHIVKL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 13-docosenoate (CAS 37910-77-3), with molecular formula C24H46O2 and molecular weight 366.35 g/mol. IUPAC: ethyl docos-13-enoate.
Chemical Property Profile of Ethyl 13-docosenoate
Property Insights of Ethyl 13-docosenoate
The XLogP value of 10.1 indicates that Ethyl 13-docosenoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl 13-docosenoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 13-docosenoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 13-docosenoate?
The CAS number of Ethyl 13-docosenoate is 37910-77-3.
What is the molecular formula of Ethyl 13-docosenoate?
The molecular formula of Ethyl 13-docosenoate is C24H46O2.
What is the molecular weight of Ethyl 13-docosenoate?
The molecular weight of Ethyl 13-docosenoate is 366.35 g/mol.
Where can I buy Ethyl 13-docosenoate?
You can request a quote for Ethyl 13-docosenoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 13-docosenoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 13-docosenoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.